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TpTp structure
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TpTp

TL;DR: TpTp (CAS 1144515-97-8) is a chemical compound with molecular formula C20H28N4O15P2 and molecular weight 626.10266 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[(2R,3S,5S)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] [(2R,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate

Also Known As: TpTp, d(Ptpt), KST-1A3495, Thymidylyl-(3'-5')-3'-thymidylic acid, 2,6,14-tris(diphenylamino)triptycene

CAS Number
1144515-97-8
Molecular Formula
C20H28N4O15P2
Molecular Weight
626.10266 g/mol
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Technical Specifications

Molecular FormulaC20H28N4O15P2
Molecular Weight626.10266 g/mol
XLogP-4.2
Topological Polar Surface Area (TPSA)260.0 Ų
Hydrogen Bond Donors6
Hydrogen Bond Acceptors15
Rotatable Bonds10
Exact Mass626.10266 Da
Heavy Atoms41
Complexity1270.0
SMILESCC1=CN(C(=O)NC1=O)[C@@H]2C[C@@H]([C@H](O2)CO)OP(=O)(O)OC[C@@H]3[C@H](C[C@@H](O3)N4C=C(C(=O)NC4=O)C)OP(=O)(O)O
InChIKeyLPGUBBCKPSUVTG-UGYDUONOSA-N

Chemical Property Profile of TpTp

XLogP
-4.2
TPSA (Topological Polar Surface Area)
260.0
Hydrogen Bond Donors
6
Hydrogen Bond Acceptors
15
Rotatable Bonds
10
Heavy Atoms
41
Complexity
1270.0
Exact Mass
626.10266
Monoisotopic Mass
626.10266
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of TpTp

The XLogP value of -4.2 indicates that TpTp is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 260.0 Ų indicates high polarity, suggesting TpTp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, TpTp has 6 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of TpTp?

The CAS number of TpTp is 1144515-97-8.

What is the molecular formula of TpTp?

The molecular formula of TpTp is C20H28N4O15P2.

What is the molecular weight of TpTp?

The molecular weight of TpTp is 626.10266 g/mol.

Where can I buy TpTp?

You can request a quote for TpTp directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for TpTp?

Yes, CoreyChem provides custom synthesis services for TpTp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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